Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | SHBG | P04278 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5710254 | 0.83 | HSP90AA1 (0.55) | ALDH1A1TSHRHSP90AA1GABRA1GABRB2 | |
| SCHEMBL196227 | 0.80 | GABRA1 (0.57) | ALDH1A1TSHRHSPA5GABRA1GABRB2 | |
| SCHEMBL66634 | 0.78 | LMNA (0.55) | ALDH1A1TSHRHSPA5GABRA1GABRB2 | |
| SCHEMBL11686142 | 0.78 | HSPA5 (0.67) | TSHRHSPA5GABRA1GABRB2IDO1 | |
| 2-Chlorophenol SCHEMBL8961529 | 0.78 | ALDH1A1 (1.00) | ALDH1A1TSHRHSPA5LMNAKDM4E | |
| 2-Chlorophenol SCHEMBL12279 | 0.78 | — | — | |
| 2-Chlorophenol SCHEMBL29354452 | 0.78 | — | — | |
| 2-Chlorophenol SCHEMBL28504762 | 0.76 | ALDH1A1 (0.75) | ALDH1A1TSHRHSPA5HSP90AA1LMNA | |
| SCHEMBL96359 | 0.75 | — | — | |
| 2-Chlorophenol SCHEMBL10882437 | 0.75 | ALDH1A1 (0.94) | ALDH1A1TSHRHSPA5LMNAKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4614826-A | CURABLE TO EPOXY RESINS; HEAT RESISTANCE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1986-09-30 | — | — | US | disclosed |